Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 8/20 | 0.54 |
| ▸ | TDO2 | P48775 | 8/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | KMO | O15229 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.42 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.42 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.42 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.42 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.42 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.42 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.42 |
| ▸ | EIF4A3 | P38919 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28844729 | 0.86 | PRKCZ (0.43) | IDO1TDO2PTGS2PTGS1 | |
| SCHEMBL1144985 | 0.81 | KDM4E (0.77) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL22394891 | 0.74 | IDO1 (0.65) | IDO1TDO2EIF4A3 | |
| SCHEMBL1144591 | 0.73 | KDM4E (0.77) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL1810986 | 0.72 | RAB9A (0.51) | PTGS2PTGS1KMOAKR1C3AKR1C2 | |
| SCHEMBL22747188 | 0.72 | IDO1 (0.75) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL29974758 | 0.72 | IDO1 (0.75) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL24113316 | 0.71 | IDO1 (0.52) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL24112536 | 0.71 | KDM4E (0.60) | IDO1TDO2KDM4EHPGDEIF4A3 | |
| SCHEMBL31652065 | 0.71 | IDO1 (0.50) | IDO1TDO2KDM4EHPGDAKR1C3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483366-B | Indole compound and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-09-16 | — | — | CN | disclosed |